⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8859787 | 1.00 | — | — | |
| SCHEMBL220049 | 1.00 | — | — | |
| Iodide SCHEMBL1486962 | 0.82 | — | — | |
| Water SCHEMBL2427426 | 0.82 | — | — | |
| SCHEMBL276353 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL640768 | 0.82 | — | — | |
| SCHEMBL614877 | 0.82 | — | — | |
| Fluoride SCHEMBL143446 | 0.82 | — | — | |
| Hydrogen Sulfide SCHEMBL3889275 | 0.82 | — | — | |
| Fluoride SCHEMBL18490705 | 0.82 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116130547-A | Preparation method of gallium arsenide solar cell multilayer epitaxial structure test sample | 天津蓝天太阳科技有限公司 | 2023-05-16 | — | — | CN | disclosed |